6-bromanyl-2-[4-[[ethoxy(ethylsulfanyl)phosphoryl]oxymethyl]phenyl]-4-methylsulfanyl-quinazoline

Systemtic Name: 6-bromanyl-2-[4-[[ethoxy(ethylsulfanyl)phosphoryl]oxymethyl]phenyl]-4-methylsulfanyl-quinazoline Openeye Name: 6-bromo-2-[4-[[ethoxy(ethylsulfanyl)phosphoryl]oxymethyl]phenyl]-4-methylsulfanyl-quinazoline CAS Name: 6-bromo-2-[4-[[ethoxy-(ethylthio)phosphoryl]oxymethyl]phenyl]-4-(methylthio)quinazoline IUPAC Name: 6-bromo-2-[4-[[ethoxy(ethylsulfanyl)phosphoryl]oxymethyl]phenyl]-4-methylsulfanylquinazoline Traditional Name: 6-bromo-2-[4-[[ethoxy-(ethylthio)phosphoryl]oxymethyl]phenyl]-4-(methylthio)quinazoline Formula: C20H22BrN2O3PS2 MolecularWeight: 513.408041

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(OCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=N2)SC)SCC

Isomeric SMILES

CCOP(=O)(OCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=N2)SC)SCC

InChI

InChI=1S/C20H22BrN2O3PS2/c1-4-25-27(24,29-5-2)26-13-14-6-8-15(9-7-14)19-22-18-11-10-16(21)12-17(18)20(23-19)28-3/h6-12H,4-5,13H2,1-3H3